{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.415221 -13.9016186 1.2597827 ] [ -5.7532784 2.0788929 -13.609472 ] [ 9.6366127 10.7478412 9.2785239 ] [ -0.3068357 2.1142434 0.4394294 ] [ 0.8387225 -1.0393588 2.631736 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.073963861865196e-09 -2.227284831219843e-08 2.0183943892283e-09 ] [ -9.217768145433632e-09 3.330753601527113e-09 -2.180477785983222e-08 ] [ 1.543955557164437e-08 1.721993989471102e-08 1.486583406811404e-08 ] [ -4.916049849668026e-10 3.387391346160703e-09 7.040435111721716e-10 ] [ 1.343781580838928e-09 -1.665236369982743e-09 4.216505891317709e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.151312 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.267290124004649e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0993132 0.2464287 2.574772 ] [ 0.0931758 1.8413397 0.8428232 ] [ 1.411312 2.1909719 2.7767887 ] [ 2.0105174 0.5079965 1.2248497 ] [ 2.2440343 2.7804449 0.6548789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.931320000000001e-12 2.464287e-11 2.574772e-10 ] [ 9.31758e-12 1.8413397e-10 8.428232e-11 ] [ 1.411312e-10 2.1909719e-10 2.7767887e-10 ] [ 2.0105174e-10 5.079965e-11 1.2248497e-10 ] [ 2.2440343e-10 2.7804449e-10 6.548789000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.86e-05 -1.42e-05 -1.15e-05 ] [ 1.77e-05 6.7e-06 6e-07 ] [ 2.43e-05 8.1e-06 1.47e-05 ] [ 1.6e-05 1.69e-05 8.4e-06 ] [ -2.94e-05 -1.75e-05 -1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.582225135488e-14 -2.275090801536e-14 -1.84250311392e-14 ] [ 2.835852618816e-14 1.073458335936e-14 9.6130597248e-16 ] [ 3.893289188544e-14 1.297763062848e-14 2.355199632576e-14 ] [ 2.56348259328e-14 2.707678489152e-14 1.345828361472e-14 ] [ -4.710399265152e-14 -2.8038090864e-14 -1.954655477376e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }